SCHEMBL12787142

SCHEMBL12787142

CC(=O)CC(=O)CCc1ccc(N)cc1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
F2RL1 P55085 1/20 0.51
GFER P55789 1/20 0.46
MMP12 P39900 1/20 0.46
ALDH1A1 P00352 1/20 0.46
ALOX5 P09917 1/20 0.45
OR51E2 Q9H255 1/20 0.45
ESRRG P62508 1/20 0.42
TDP1 Q9NUW8 1/20 0.41
L3MBTL1 Q9Y468 1/20 0.41
MAOB P27338 3/20 0.41
MAOA P21397 2/20 0.41
KDM4E B2RXH2 1/20 0.41
KDM6B O15054 1/20 0.41
KDM5C P41229 1/20 0.41
EGLN1 Q9GZT9 1/20 0.41
PHF8 Q9UPP1 1/20 0.41
KDM2A Q9Y2K7 1/20 0.41
POLB P06746 1/20 0.39
RECQL P46063 1/20 0.39
IAPP P10997 1/20 0.39

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL1404834 0.84 ALDH1A1 (0.63) GFERALDH1A1ESRRGTDP1MAOB
SCHEMBL27815775 0.84 GFER (0.59) F2RL1GFERMMP12ALDH1A1TDP1
SCHEMBL4021741 0.83 F2RL1 (0.53) F2RL1MMP12ALDH1A1ALOX5OR51E2
SCHEMBL12354595 0.83 F2RL1 (0.53) F2RL1MMP12ALDH1A1ALOX5OR51E2
SCHEMBL1645396 0.83 KDM4E (0.55) F2RL1MMP12ALDH1A1ALOX5OR51E2
SCHEMBL13577768 0.83 TDP1 (0.59) F2RL1MMP12ALDH1A1ALOX5OR51E2
SCHEMBL28813051 0.82 F2RL1 (0.57) F2RL1GFERMMP12ALDH1A1ALOX5
SCHEMBL8014395 0.81 IAPP (0.58) F2RL1GFERMMP12ESRRGTDP1
SCHEMBL2206622 0.81 ALDH1A1 (0.70) F2RL1MMP12ALDH1A1ALOX5TDP1
SCHEMBL10909492 0.79 TDP1 (0.59) F2RL1GFERTDP1L3MBTL1IAPP

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2011046946-A2 BIFUNCTIONAL MOLECULES WITH ANTIBODY-RECRUITING AND ENTRY INHIBITORY ACTIVITY AGAINST THE HUMAN IMMUNODEFICIENCY VIRUS YALE UNIVERSITY (US) 2011-04-21 WO disclosed
EP-0870014-B9 ALDOLASE CATALYTIC ANTIBODY SCRIPPS RESEARCH INST (US) 2007-10-10 EP disclosed
EP-0870014-B1 ALDOLASE CATALYTIC ANTIBODY SCRIPPS RESEARCH INST (US) 2007-02-21 EP disclosed